Basic information
- CAS
1335-63-3- Standard SMILES
O=C(O)c1ccccc1C(=O)O.OC1CCCCC1- InChIKey
QQLNNDNTWFIZAU-UHFFFAOYSA-N- Molecular formula
- C14H18O5
- Average molar mass
- 266.29 g/mol
- Monoisotopic mass
- 266.11542367
Names & identifiers
- Preferred name
- 1,2-Benzenedicarboxylic acid, cyclohexyl ester
- IUPAC
- cyclohexanol;phthalic acid
Names & synonyms
Cyclohexyl phthalate1,2-Benzenedicarboxylic acid, cyclohexyl ester1335-63-3RefChem:71658DTXSID10891143SCHEMBL4824063
Database identifiers
- CAS
1335-63-3- PubChem CID
- 102115
Properties
Computed structural properties
- Topological polar surface area
- 94.8 Ų
- Hydrogen bond donors
- 3
- Hydrogen bond acceptors
- 5
- Rotatable bonds
- 2
- Heavy atoms
- 19
- Formal charge
- 0
- Complexity
- 223
Experimental & physicochemical properties
PolymersPlastics & Rubber -> Phthalate Esters
Safety & regulation
Safety information is for reference only and does not replace the supplier’s Safety Data Sheet (SDS), applicable regulations, or professional assessment.
Hazard information
Regulatory InformationChemical: Phthalic acid, cyclohexyl ester
Other Safety InformationEvaluation - Chemicals not considered for in depth evaluation - Not commercially active in Australia
Hazards SummarySee PHTHALATE ESTERS.
Chemistry & industry
Uses & manufacturing
General Manufacturing Information1,2-Benzenedicarboxylic acid, cyclohexyl ester: INACTIVE
Related reactions
0 records
No reaction records under the current filter.
Compound notes
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